{"id":"W3022352011","doi":"10.1039/d0ob00910e","title":"Efficient synthesis of a galectin inhibitor clinical candidate (TD139) using a Payne rearrangement/azidation reaction cascade","year":2020,"lang":"en","type":"article","venue":"Organic & Biomolecular Chemistry","topic":"Galectins and Cancer Biology","field":"Immunology and Microbiology","cited_by":26,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université Laval","funders":"Natural Sciences and Engineering Research Council of Canada; Fonds de recherche du Québec – Nature et technologies; Université Laval","keywords":"Cascade; Cascade reaction; Rearrangement reaction; Chemistry; Combinatorial chemistry; Biochemistry; Chromatography","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002136393,0.0003657662,0.0002605387,0.0002629945,0.0001535939,0.0002200371,0.0002123949,0.0003502153,0.002632585],"category_scores_gemma":[0.0002250187,0.0001106112,0.0002542596,0.0002266415,0.0001823508,0.0003054185,0.00033977,0.0007069023,0.0007847793],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000215432,"about_ca_system_score_gemma":0.0004051978,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000272719,"about_ca_topic_score_gemma":0.0004067987,"domain_scores_codex":[0.9998894,0.00001815686,0.000007786087,0.00002467913,0.000027815,0.00003223078],"domain_scores_gemma":[0.9999533,0.000009192161,0.00001147825,0.000006245512,0.000008680856,0.00001118835],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001716518,0.0001288512,0.0001902584,0.0002496693,0.00002577402,0.0003939212,0.0000700896,0.0008042877,0.9754645,0.002203984,0.0005518195,0.0197453],"study_design_scores_gemma":[0.0001041114,0.001625495,0.0007521627,0.00001667115,0.00003924776,0.0008892206,0.00002494114,0.001304881,0.9767404,0.0004433691,0.01802965,0.00002996143],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8558634,0.007035639,0.108633,0.0008393162,0.0002968145,0.001002456,0.001219318,0.0005929763,0.02451718],"genre_scores_gemma":[0.9672403,0.002537243,0.02399661,0.0002201507,0.0000393062,0.0001890487,0.0006109416,0.00004950111,0.005116986],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002632585,"threshold_uncertainty_score":0.008806884,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01710542831153293,"score_gpt":0.2672329573816195,"score_spread":0.2501275290700865,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}